Geometry & MOs

Info

ID:	295417
PubChem CID:	117528395
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	244.121178
ΔH_f, kcal/mol:	-63.21
Dipole, Da:	2.81
IP(EA), eV:	-8.75(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclobutyl-3-methylbenzimidazole-5-carboxylate

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C)C=C(C=C2)CC(=O)OC

DOS

IR

Vibrations